| SpectraBase Spectrum ID |
jPW8uBnHvQ |
| Name |
7-(4-Methylpentyl)-1,5-benzodioxepin-3-one |
| Alternate Name(s) |
7-isohexyl-1,5-benzodioxepin-3-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H20O3 |
| InChI |
InChI=1S/C15H20O3/c1-11(2)4-3-5-12-6-7-14-15(8-12)18-10-13(16)9-17-14/h6-8,11H,3-5,9-10H2,1-2H3 |
| InChIKey |
HJMKQSMNOIVDCL-UHFFFAOYSA-N |
| Molecular Weight |
248.322 g/mol |
| SMILES |
c12OCC(COc2ccc(c1)CCCC(C)C)=O |
| SPLASH |
splash10-004i-1930000000-a9b03bd777b893f11a93 |
| Source of Spectrum |
K1-2003-3740-18 |
| Wiley ID |
1521535 |
